3-[(8R,9S,10R,13S,14S)-7,17-Dihydroxy-10,13-Dimethyl-3-Oxo-6,7,8,9,10,11,12,13,14,15,16,17-Dodecahydro-3H-Cyclopenta[A]Phenanthren-17-Yl]Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C22H30O5 |
| IUPAC Name | 3-[(7r,8r,9s,10r,13s,14s,17s)-7,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6h-cyclopenta[a]phenanthren-17-yl]propanoic acid |
| Molecular Mass | 374.471 g·mol−1 |
| Heat of Formation | -985.1 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.43 ± 1.08 D |
| Volume | 456.15 Å 3 |
| Surface Area | 360.69 Å 2 |
| HOMO Energy | -9.98 ± 0.55 eV |
| LUMO Energy | -0.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | IQQLBOYJTIWJEV-HYISFEOESA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |